Vitas-M small molecule compound

2-(2-amino-2-oxoethyl)-1-methyl-3,4-dihydroisoquinolinium

Catalog ID
STL553459
SMILES NC(=O)C[N+]1=C(C)c2c(CC1)cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H15N2O MW 203.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O/c1-9-11-5-3-2-4-10(11)6-7-14(9)8-12(13)15/h2-5H,6-8H2,1H3,(H-,13,15)/p+1
InChIKey
KTDPULOLKXSLBN-UHFFFAOYSA-O
Synonyms

1759641
2(1METHYL34DIHYDROISOQUINOLIN2IUM2YL)ACETAMIDE
2(2amino2oxoethyl)1methyl34dihydroisoquinolin2iumchloride
2(2amino2oxoethyl)1methyl34dihydroisoquinolinium
InChI=1SC12H14N2Oc1911532410(11)6714(9)812(13)15h25H68H21H3(H1315)p+1
NC(=O)C(N+)1=C(C)c2c(CC1)cccc2(Cl)
ZINC000002104638
ZINC2104638

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.